Record Information |
---|
Version | 2.0 |
---|
Created at | 2024-09-16 04:52:22 UTC |
---|
Updated at | 2024-09-25 11:51:40 UTC |
---|
NP-MRD ID | NP0341809 |
---|
Natural Product DOI | https://doi.org/10.57994/3295 |
---|
Secondary Accession Numbers | None |
---|
Natural Product Identification |
---|
Common Name | paraisariamide D |
---|
Description | It was first documented in 2024 (PMID: 39298800). Based on a literature review a significant number of articles have been published on paraisariamide D (PMID: 39298792) (PMID: 39298763) (PMID: 39298758) (PMID: 39298745). |
---|
Structure | [H][C@@]1(NC(=O)[C@@H](C)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC2=CC=CC=C2)N(C)C(=O)[C@@]([H])(NC(=O)[C@]([H])(NC1=O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC InChI=1S/C42H69N7O7/c1-14-25(6)33-38(52)45-34(26(7)15-2)39(53)46-35(27(8)16-3)42(56)49(13)32(23-30-20-18-17-19-21-30)37(51)43-31(22-24(4)5)41(55)48(12)29(10)40(54)47(11)28(9)36(50)44-33/h17-21,24-29,31-35H,14-16,22-23H2,1-13H3,(H,43,51)(H,44,50)(H,45,52)(H,46,53)/t25-,26-,27-,28+,29-,31-,32-,33+,34+,35-/m0/s1 |
---|
Synonyms | Not Available |
---|
Chemical Formula | C42H69N7O7 |
---|
Average Mass | 784.0560 Da |
---|
Monoisotopic Mass | 783.52585 Da |
---|
IUPAC Name | (3S,6S,9S,12S,15R,18R,21R)-9-benzyl-12,15,18-tris[(2S)-butan-2-yl]-1,3,4,10,21-pentamethyl-6-(2-methylpropyl)-1,4,7,10,13,16,19-heptaazacyclohenicosane-2,5,8,11,14,17,20-heptone |
---|
Traditional Name | (3S,6S,9S,12S,15R,18R,21R)-9-benzyl-12,15,18-tris[(2S)-butan-2-yl]-1,3,4,10,21-pentamethyl-6-(2-methylpropyl)-1,4,7,10,13,16,19-heptaazacyclohenicosane-2,5,8,11,14,17,20-heptone |
---|
CAS Registry Number | Not Available |
---|
SMILES | [H][C@@]1(NC(=O)[C@@H](C)N(C)C(=O)[C@H](C)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](CC2=CC=CC=C2)N(C)C(=O)[C@@]([H])(NC(=O)[C@]([H])(NC1=O)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC |
---|
InChI Identifier | InChI=1S/C42H69N7O7/c1-14-25(6)33-38(52)45-34(26(7)15-2)39(53)46-35(27(8)16-3)42(56)49(13)32(23-30-20-18-17-19-21-30)37(51)43-31(22-24(4)5)41(55)48(12)29(10)40(54)47(11)28(9)36(50)44-33/h17-21,24-29,31-35H,14-16,22-23H2,1-13H3,(H,43,51)(H,44,50)(H,45,52)(H,46,53)/t25-,26-,27-,28+,29-,31-,32-,33+,34+,35-/m0/s1 |
---|
InChI Key | NOIPLVHOJQLSQA-MIXCUGQXSA-N |
---|
Experimental Spectra |
---|
|
| Spectrum Type | Description | Depositor Email | Depositor Organization | Depositor | Deposition Date | View |
---|
HSQC NMR | [1H, 13C] NMR Spectrum (2D, 800 MHz, CDCl3, experimental) | rmtehan@utica.edu | Utica University, Oregon State University | Richard Tehan | 2024-09-16 | View Spectrum | HMBC NMR | [1H, 13C] NMR Spectrum (2D, 800 MHz, CDCl3, experimental) | rmtehan@utica.edu | Utica University, Oregon State University | Richard Tehan | 2024-09-16 | View Spectrum | COSY NMR | [1H, 1H] NMR Spectrum (2D, 800 MHz, CDCl3, experimental) | rmtehan@utica.edu | Utica University, Oregon State University | Richard Tehan | 2024-09-16 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 800 MHz, CDCl3, experimental) | rmtehan@utica.edu | Utica University, Oregon State University | Richard Tehan | 2024-09-16 | View Spectrum |
| Predicted Spectra |
---|
|
| Spectrum Type | Description | Depositor ID | Depositor Organization | Depositor | Deposition Date | View |
---|
| Chemical Shift Submissions |
---|
|
| Not Available | Species |
---|
Species of Origin | Species Name | Source | Reference |
---|
cascadensis | | |
|
---|
Chemical Taxonomy |
---|
Classification | Not classified |
---|
Physical Properties |
---|
State | Not Available |
---|
Experimental Properties | Property | Value | Reference |
---|
Melting Point | Not Available | Not Available | Boiling Point | Not Available | Not Available | Water Solubility | Not Available | Not Available | LogP | Not Available | Not Available |
|
---|
Predicted Properties | |
---|
General References | - Kwak M Kwak, Succi PJ, Benitez B, Mitchinson CJ, Bergstrom HC: The effects of sex and contraction intensity on fatigability and muscle oxygenation in trained individuals. Appl Physiol Nutr Metab. 2024 Sep 19. doi: 10.1139/apnm-2024-0181. [PubMed:39298792 ]
- Bell EC, O'Halloran P, Pazzinatto MF, Wallis JA, Crossley KM, Kemp JL, Perraton Z, Barton CJ: "I feel more confident": a mixed methods evaluation of the influence of Good Life with osteoarthritis Denmark (GLA:D(R)) on physical activity participation, capability, barriers, and facilitators in people with knee osteoarthritis. Braz J Phys Ther. 2024 Sep 5;28(5):101113. doi: 10.1016/j.bjpt.2024.101113. [PubMed:39298800 ]
- Weiner LS, Crowley RN, Sheeber LB, Koegler FH, Davis JF, Wells M, Funkhouser CJ, Auerbach RP, Allen NB: Engagement, Acceptability, and Effectiveness of the Self-Care and Coach-Supported Versions of the Vira Digital Behavior Change Platform Among Young Adults at Risk for Depression and Obesity: Pilot Randomized Controlled Trial. JMIR Ment Health. 2024 Sep 19;11:e51366. doi: 10.2196/51366. [PubMed:39298763 ]
- Winter JD, Kerns JW, Brandt N, Wastila L, Qato D, Sabo RT, Petterson S, Chung Y, Reves S, Winter C, Winter KM, Elonge E, Ewasiuk C, Fu YH, Funk A, Krist A, Etz R: Prescribing Trends and Associated Outcomes of Antiepileptic Drugs and Other Psychotropic Medications in US Nursing Homes: Proposal for a Mixed Methods Investigation. JMIR Res Protoc. 2024 Sep 19;13:e64446. doi: 10.2196/64446. [PubMed:39298758 ]
- Sun B, Zhang W, Zheng M, Meng J, Liu L, Ma G, Yao Q, Wang M: Leaf-like Multiphase Metal Phosphides as Bifunctional Oxygen Electrocatalysts toward Rechargeable Zinc-Air Batteries. Inorg Chem. 2024 Sep 19. doi: 10.1021/acs.inorgchem.4c03022. [PubMed:39298745 ]
|
---|